chempirical

Cyclohexylthiophthalimide

C14H15NO2SCAS 17796-82-6261.34 g/mol

Open in Covalent MOL file
OONS
AmideLactam

Properties

Molecular formula
C14H15NO2S
Molar mass
261.34 g/mol
Exact mass
261.0823 Da
Melting point
93–94 °C
logP
3.26Crippen estimate
Polar surface area
37.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Identifiers

CAS number
17796-82-6
SMILES
O=C1c2ccccc2C(=O)N1SC1CCCCC1
InChIKey
UEZWYKZHXASYJN-UHFFFAOYSA-N
InChI
InChI=1S/C14H15NO2S/c16-13-11-8-4-5-9-12(11)14(17)15(13)18-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

24 names · show all
  • 1H-Isoindole-1,3(2H)-dione, 2-(cyclohexylthio)-
  • Phthalimide, N-(cyclohexylthio)-
  • 2-(Cyclohexylthio)-1H-isoindole-1,3(2H)-dione
  • N-(Cyclohexylthio)phthalimide
  • Santogard PVI
  • N-Cyclohexylsulfenylphthalimide
  • Santogard PVI-DS
  • Duslin P
  • Vulkalent G
  • Retarder CTP
  • Accitard RE
  • Duslin PP
  • Rhenogran CPT 80
  • CTP
  • CTP (chinese inhibitor)
  • 2-(Cyclohexylthio)isoindoline-1,3-dione
  • PVI
  • Anscorch CTP
  • Vulkalent P
  • Pilgard PVI
  • CTP-PVI
  • 2-Cyclohexylsulfanylisoindole-1,3-dione
  • 2-(Cyclohexylsulfanyl)-2,3-dihydro-1H-isoindole-1,3-dione
  • SF 205

Work with Cyclohexylthiophthalimide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2′-Thiobis[1H-isoindole-1,3(2H)-dione]7764-29-653 % similar Folpet133-07-345 % similar 2-(4-Oxocyclohexyl)-1H-isoindole-1,3(2H)-dione104618-32-843 % similar 1,3-Dihydro-1,3-dioxo-2H-isoindole-2-acetaldehyde2913-97-542 % similar 2-(Chloromethyl)-1H-isoindole-1,3(2H)-dione17564-64-642 % similar Dicyclohexyl phthalate84-61-741 % similar N-(Hydroxymethyl)phthalimide118-29-641 % similar 2-(Phenylmethyl)-1H-isoindole-1,3(2H)-dione2142-01-041 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-Benzyl-P-toluenesulfonamide1576-37-0 2-Amino-3-carboethoxy-5-methyl-4-phenylthiophene4815-37-6

Elsewhere

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